CID 132398760

1-(bromomethyl)-3-fluorocyclopentane

Structural Information

Molecular Formula
C6H10BrF
SMILES
C1CC(CC1CBr)F
InChI
InChI=1S/C6H10BrF/c7-4-5-1-2-6(8)3-5/h5-6H,1-4H2
InChIKey
LDZGRVGOHNAIGD-UHFFFAOYSA-N
Compound name
1-(bromomethyl)-3-fluorocyclopentane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.995 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.00228 134.8
[M+Na]+ 202.98422 145.9
[M-H]- 178.98772 139.7
[M+NH4]+ 198.02882 160.1
[M+K]+ 218.95816 135.9
[M+H-H2O]+ 162.99226 135.1
[M+HCOO]- 224.99320 154.7
[M+CH3COO]- 239.00885 178.1
[M+Na-2H]- 200.96967 139.9
[M]+ 179.99445 149.3
[M]- 179.99555 149.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.